%chk=000288579.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288579

0 1
O -1.194601 -2.455102 -1.122666
O -0.424176 0.967029 0.935994
O -0.519787 1.863429 -1.117426
N 2.142592 0.100168 -1.641445
N -0.837469 -1.857654 1.063142
C 1.973643 -0.963708 0.372472
C 1.649019 -1.940430 1.442793
C 2.721282 0.256938 0.570194
C 2.801771 0.909931 -0.707609
C 0.354319 -2.733101 1.197613
C 1.632694 -1.029806 -0.971820
C 3.331483 0.862620 1.686526
C 3.461103 2.147971 -0.872094
C 3.975970 2.074121 1.519341
C 4.038201 2.711195 0.249160
C -1.476563 -1.744798 -0.169823
C -2.623500 -0.765718 -0.198745
C -2.426435 0.621339 -0.243209
C -3.924667 -1.283308 -0.229718
C -3.525325 1.488884 -0.317587
C -5.020323 -0.417259 -0.293178
C -4.821314 0.966519 -0.336621
C -1.062694 1.219362 -0.253741
H 1.591203 -1.417084 2.421285
H 2.492994 -2.660166 1.545542
H 0.452397 -3.367936 0.282639
H 0.168033 -3.426071 2.049746
H 1.062136 -1.787328 -1.493695
H 1.962438 0.335861 -2.599314
H 3.294149 0.371734 2.655941
H 3.503529 2.629136 -1.843970
H -0.901749 -1.086074 1.733528
H 4.454441 2.561184 2.366425
H 4.557745 3.665855 0.172527
H -4.077830 -2.364605 -0.212853
H -3.366943 2.567948 -0.365309
H -6.032155 -0.823805 -0.314458
H -5.676898 1.640145 -0.391042
H 0.537187 1.271584 0.935055


%chk=000288579-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288579

0 1
O -2.186413 -2.975397 -0.183910
O -0.325631 1.058743 1.038653
O -0.886770 2.395244 -0.763567
N 3.232930 -0.359758 -1.732359
N -0.555503 -1.637326 0.754914
C 2.427231 -1.278769 0.205504
C 1.822815 -2.256598 1.191007
C 2.771353 0.111657 0.451588
C 3.267040 0.665854 -0.784763
C 0.405461 -2.749205 0.808197
C 2.727062 -1.524110 -1.136309
C 2.691155 0.958534 1.594232
C 3.670705 2.013955 -0.905103
C 3.086935 2.307959 1.476526
C 3.570647 2.830261 0.238818
C -1.806504 -1.826080 0.229166
C -2.784271 -0.649451 0.160803
C -2.518794 0.753390 0.013665
C -4.141640 -1.071835 0.121314
C -3.603998 1.651951 -0.200893
C -5.208274 -0.167454 -0.035749
C -4.938432 1.208762 -0.207419
C -1.192316 1.457969 0.006735
H 1.789159 -1.795126 2.196962
H 2.463028 -3.154330 1.290729
H 0.417098 -3.254895 -0.175805
H 0.061368 -3.508168 1.539617
H 2.608178 -2.439187 -1.714215
H 3.508319 -0.271181 -2.707971
H 2.349978 0.566525 2.559638
H 4.039062 2.420643 -1.853388
H -0.286146 -0.702198 1.091174
H 3.033713 2.966802 2.350162
H 3.866650 3.882827 0.178847
H -4.323143 -2.148845 0.184976
H -3.372244 2.709437 -0.362538
H -6.239484 -0.536339 -0.045025
H -5.752945 1.925411 -0.355682
H 0.558523 1.529329 0.985070


